For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

CISAPRIDE-ARTIFACT 1

View entire compound with spectra: 1 MS (GC)

CISAPRIDE-ARTIFACT 1
SpectraBase Compound ID 5aKyLqTlTdM
InChI InChI=1S/C21H23ClFN3O3/c22-18-12-17(20(27)13-19(18)24)21(28)25-15-6-9-26(10-7-15)8-1-11-29-16-4-2-14(23)3-5-16/h2-6,9,12-13,15,27H,1,7-8,10-11,24H2,(H,25,28)
InChIKey FQAYIFZOVVDGOB-UHFFFAOYSA-N
Mol Weight 419.88 g/mol
Molecular Formula C21H23ClFN3O3
Exact Mass 419.141197 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID CCRou4Y5OOr
Name CISAPRIDE-ARTIFACT 1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C21H23ClFN3O3
InChI InChI=1S/C21H23ClFN3O3/c22-18-12-17(20(27)13-19(18)24)21(28)25-15-6-9-26(10-7-15)8-1-11-29-16-4-2-14(23)3-5-16/h2-6,9,12-13,15,27H,1,7-8,10-11,24H2,(H,25,28)
InChIKey FQAYIFZOVVDGOB-UHFFFAOYSA-N
Instrument Name GC
Molecular Weight 419.884 g/mol
SMILES Oc1c(C(NC2C=CN(CCCOc3ccc(F)cc3)CC2)=O)cc(c(c1)N)Cl
SPLASH splash10-001i-8690000000-d3337377e0ca98605728
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany